Scientific Reports (Nov 2024)

Anisotropy parameters from shapes of ion-ion correlation features of fragmenting molecules

  • Emelie Olsson,
  • Måns Wallner,
  • Richard J. Squibb,
  • Veronica Ideböhn,
  • Marco Parriani,
  • Michael A. Parkes,
  • Stephen D. Price,
  • John H.D. Eland,
  • Raimund Feifel

DOI
https://doi.org/10.1038/s41598-024-80014-z
Journal volume & issue
Vol. 14, no. 1
pp. 1 – 9

Abstract

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Abstract When a molecule loses two electrons, Coulomb repulsion makes the resulting doubly charged system likely to fragment into two singly charged ions. These monocations can be detected in a correlated fashion using multiplex time-of-flight spectroscopy. The island shapes in the ion-ion coincidence maps derived from such two-body dissociations contain detailed information on the physical processes underlying the fragmentation. Here, a simple method is presented where a fit function is used to determine the anisotropy parameter β of the molecular distribution from the peak shape of the time-of-flight difference of the two ions. The validity of the method is demonstrated by performing fits to simulated peak shapes, recovering the β value of the input angular distribution, and by comparison of experimental peak shapes to β values known from the literature.